Ethanol → 4-(3-trifluoromethyl-phenyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-5'-ylamine
반응식
[CH3:26][CH2:27][OH:28].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH2:12][CH:13]([c:16]3[cH:17][c:18]([C:22]([F:23])([F:24])[F:25])[cH:19][cH:20][cH:21]3)[CH2:14][CH2:15]2)[n:8][cH:9]1>>[NH2:1][c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH2:12][CH:13]([c:16]3[cH:17][c:18]([C:22]([F:23])([F:24])[F:25])[cH:19][cH:20][cH:21]3)[CH2:14][CH2:15]2)[n:8][cH:9]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-87432500807c4106b104c44353e59968
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
반응 노트
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